Chemical Properties of 2'-Chlorobenzenesulfonanilide (CAS 21226-30-2)

InChI

InChI=1S/C12H10ClNO2S/c13-11-8-4-5-9-12(11)14-17(15,16)10-6-2-1-3-7-10/h1-9,14H

InChI Key

KMSWCQQQRKBBAH-UHFFFAOYSA-N

Formula

C12H10ClNO2S

SMILES

O=S(=O)(Nc1ccccc1Cl)c1ccccc1

Molecular Weight¹

267.73

CAS

21226-30-2

Other Names

• N-(2-chlorophenyl)benzene sulfonamide
• N-(2-chlorophenyl)benzenesulfonamide

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[223.69; 512.72]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.66100e+01
Coefficient B			1.04309e+00
Coefficient C			-6.27760e-04
Coefficient D			1.14000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	223.69	J/mol×K	273.00	Calculated Property
Cp,gas	278.89	J/mol×K	353.78	Calculated Property
Cp,gas	327.48	J/mol×K	434.56	Calculated Property
Cp,gas	369.82	J/mol×K	515.33	Calculated Property
Cp,gas	406.26	J/mol×K	596.11	Calculated Property
Cp,gas	437.18	J/mol×K	676.89	Calculated Property
Cp,gas	462.92	J/mol×K	757.67	Calculated Property
Cp,gas	483.85	J/mol×K	838.44	Calculated Property
Cp,gas	500.33	J/mol×K	919.22	Calculated Property
Cp,gas	512.72	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 2'-Chlorobenzenesulfonanilide.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Impact of Sulfonamide Structure on Solubility and Transfer Processes in Biologically Relevant Solvents
• Octanol/Water Partition Coefficients of Sulfonamides: Experimental Determination and Calculation Using Physicochemical Descriptors
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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